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N-{3-[2',4'-Dimethyl-1'-azetidinylmethyl]phenyl-2,4-dimethylazetidine
SpectraBase Compound ID 2so8ft2KWBK
InChI InChI=1S/C17H26N2/c1-12-8-13(2)18(12)11-16-6-5-7-17(10-16)19-14(3)9-15(19)4/h5-7,10,12-15H,8-9,11H2,1-4H3/t12-,13-,14-,15-/m1/s1
InChIKey ANDODPRGRRVBPA-KBUPBQIOSA-N
Mol Weight 258.41 g/mol
Molecular Formula C17H26N2
Exact Mass 258.209599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H752HI2ZXro
Name N-{3-[2',4'-Dimethyl-1'-azetidinylmethyl]phenyl-2,4-dimethylazetidine
Alternate Name(s) (2R,4R)-N-{3-[(2'R,4'R)-2',4'-Dimethyl-1'-azetidinylmethyl]phenyl-2,4-dimethylazetidine (2R,4R)-1-[3-[[(2R,4R)-2,4-dimethyl-1-azetidinyl]methyl]phenyl]-2,4-dimethylazetidine (2R,4R)-1-[3-[[(2R,4R)-2,4-dimethylazetidin-1-yl]methyl]phenyl]-2,4-dimethylazetidine (2R,4R)-1-[3-[[(2R,4R)-2,4-dimethylazetidin-1-yl]methyl]phenyl]-2,4-dimethyl-azetidine
Comments Less than 3 mono-isotopic peaks
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Formula C17H26N2
InChI InChI=1S/C17H26N2/c1-12-8-13(2)18(12)11-16-6-5-7-17(10-16)19-14(3)9-15(19)4/h5-7,10,12-15H,8-9,11H2,1-4H3/t12-,13-,14-,15-/m1/s1
InChIKey ANDODPRGRRVBPA-KBUPBQIOSA-N
Molecular Weight 258.409 g/mol
SMILES [C@]1(N([C@@](C1)(C)[H])c1cc(CN2[C@](C)(C[C@]2(C)[H])[H])ccc1)(C)[H]
SPLASH splash10-004i-0910000000-cceb1f15da33268f3cf3
Source of Spectrum K1-2000-1819-5
Wiley ID 750260